227801 logo
canSAR227801
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CO[C@@H]1[C@@H](OC(=O)c2ccc(C)[nH]2)[C@@H](O)[C@H](Oc2ccc3c(OCCN4CCOCC4)cc(=O)oc3c2C)OC1(C)C
    InChI
    InChI=1S/C30H38N2O10/c1-17-6-8-20(31-17)28(35)41-26-24(34)29(42-30(3,4)27(26)36-5)39-21-9-7-19-22(16-23(33)40-25(19)18(21)2)38-15-12-32-10-13-37-14-11-32/h6-9,16,24,26-27,29,31,34H,10-15H2,1-5H3/t24-,26+,27-,29-/m1/s1
    MOLECULAR FORMULA
    C30H38N2O10
    CROSS REFERENCES
    227801 logo

    canSAR227801

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 586.25
    AlogP 2.56
    HBond donors 2
    HBond acceptors 12
    Atoms 80
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR227801.